Chem
J-GLOBAL ID：200907037072953720   Nikkaji number：J709.993B

2-[(E)-4′-Methoxystilben-4-yl]-4-[4-(dimethylamino)phenyl]-1,3-dioxylato-3-cyclobutene-1,2-diium

2-[(E)-4′-メトキシスチルベン-4-イル]-4-[4-(ジメチルアミノ)フェニル]-1,3-ジオキシラト-3-シクロブテン-1,2-ジイウム
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C25[C+]2H23NO[O-]2
Molecular formula furigana： C27-H23-N-O3
Molecular weight： 409.485
InChI： InChI=1S/C27H24NO3/c1-28(2)22-14-12-21(13-15-22)25-26(29)24(27(25)30)20-10-6-18(7-11-20)4-5-19-8-16-23(31-3)17-9-19/h4-17H,1-3H3,(H-,29,30)/q+1/p-1/b5-4+
InChI key： GFQVGZRLNADFKP-SNAWJCMRSA-M
SMILES： COc1ccc(/C=C/c2ccc(cc2)[C+]2=[C+]([O-])C(=C2[O-])c2ccc(cc2)N(C)C)cc1
Systematic name  (3)：
  • 2-[(E)-4′-メトキシスチルベン-4-イル]-4-[4-(ジメチルアミノ)フェニル]-1,3-ジオキシラト-3-シクロブテン-1,2-ジイウム
  • 3-[4-(ジメチルアミノ)フェニル]-1-{4-[(1E)-2-(4-メトキシフェニル)エテニル]フェニル}シクロブタ-1,3-ジエン-2-イウム-1-イリウム-2,4-ビス(オラート)
  • 3-[4-(dimethylamino)phenyl]-1-{4-[(1E)-2-(4-methoxyphenyl)ethenyl]phenyl}cyclobuta-1,3-dien-2-ium-1-ylium-2,4-bis(olate)
Other name (1)：
  • 2-[(E)-4′-Methoxystilben-4-yl]-4-[4-(dimethylamino)phenyl]-1,3-dioxylato-3-cyclobutene-1,2-diium
Thsaurus map：
Thesaurus Map

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